Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CPB1 | P15086 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28098362 | 0.84 | ALDH1A1 (0.59) | ALDH1A1LTA4HHTR2CGLATSHR | |
| Piperazine SCHEMBL28816742 | 0.79 | ALDH1A1 (0.79) | ALDH1A1HTR2CGLATSHRMAPK1 | |
| SCHEMBL3393626 | 0.77 | GLA (0.62) | ALDH1A1LTA4HHTR2CGLATSHR | |
| SCHEMBL28307564 | 0.76 | ALDH1A1 (0.59) | ALDH1A1HTR2CTSHR | |
| Azetidine SCHEMBL28049251 | 0.76 | ALDH1A1 (0.79) | ALDH1A1HTR2CGLATSHRMAPK1 | |
| SCHEMBL17069 | 0.75 | LTA4H (0.61) | LTA4HTSHRPOLBSLC6A2SLC6A3 | |
| SCHEMBL17070 | 0.75 | LTA4H (0.61) | LTA4HTSHRPOLBSLC6A2SLC6A3 | |
| SCHEMBL6299585 | 0.75 | LTA4H (0.61) | LTA4HTSHRPOLBSLC6A2SLC6A3 | |
| SCHEMBL14348098 | 0.74 | TSHR (0.43) | ALDH1A1HTR2CTSHRCPB1CYP2C9 | |
| Hydrochloric Acid SCHEMBL16259 | 0.74 | LTA4H (0.59) | LTA4HTSHRPOLBSLC6A2SLC6A3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104662015-A | Complement pathway modulators and uses thereof | NOVARTIS AG | 2015-05-27 | — | — | CN | disclosed |